Monomers

1-Octene

Identifiers

IUPAC name
oct-1-ene
InchI
InChI=1S/C8H16/c1-3-5-7-8-6-4-2/h3H,1,4-8H2,2H3
InchI Key
KWKAKUADMBZCLK-UHFFFAOYSA-N
SMILES
CCCCCCC=C
Canonical SMILES
CCCCCCC=C
Isomeric SMILES
CCCCCCC=C
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H16
Heavy Atom Count
8
Molecular Weight
112.216
Exact Molecular Weight
112.1252
Valence Electrons
48
Radical Electrons
0
tPSA
0.0
MolLogP
3.1428
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 24 23  0  0  0  0  0  0  0  0999 V2000
   -3.1029    0.9639   -0.4503 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1293   -0.0946   -0.0025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0794    0.4640    0.9316 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1178   -0.6038    1.3682 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6205   -1.2414    0.2314 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4452   -0.2859   -0.5715 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4849    0.4019    0.2096 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7820    0.3059   -0.0676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8235    0.5459   -1.1499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6653    1.3139    0.4482 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5220    1.8023   -0.8958 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6324   -0.5086   -0.9135 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6678   -0.8974    0.5411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6344    0.7863    1.8555 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6052    1.3570    0.5180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7490   -1.4220    1.8273 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5371   -0.2603    2.1932 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3118   -1.9943    0.6663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0881   -1.7481   -0.4243 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8450    0.4809   -1.0999 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9560   -0.8739   -1.3631 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2108    1.0220    1.0551 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5459    0.7977    0.4886 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0782   -0.3114   -0.9120 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  3
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  3 14  1  0
  3 15  1  0
  4 16  1  0
  4 17  1  0
  5 18  1  0
  5 19  1  0
  6 20  1  0
  6 21  1  0
  7 22  1  0
  8 23  1  0
  8 24  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers